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4-[(4-methylphenyl)sulfonylmethyl]thiophene-3-carbonitrile

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4-[(4-methylphenyl)sulfonylmethyl]thiophene-3-carbonitrile
SpectraBase Compound ID MfZBK7SK4D
InChI InChI=1S/C13H11NO2S2/c1-10-2-4-13(5-3-10)18(15,16)9-12-8-17-7-11(12)6-14/h2-5,7-8H,9H2,1H3
InChIKey BEXIEDQUSDDZQI-UHFFFAOYSA-N
Mol Weight 277.36 g/mol
Molecular Formula C13H11NO2S2
Exact Mass 277.023121 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7PV3rZyYuYX
Name 4-[(4-methylphenyl)sulfonylmethyl]thiophene-3-carbonitrile
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H11NO2S2
InChI InChI=1S/C13H11NO2S2/c1-10-2-4-13(5-3-10)18(15,16)9-12-8-17-7-11(12)6-14/h2-5,7-8H,9H2,1H3
InChIKey BEXIEDQUSDDZQI-UHFFFAOYSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2007)
Molecular Weight 277.356 g/mol
Source File Reference MHKO11584